6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione

C19H22N4O4 — CID 17403045

IUPAC6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione
SMILESCCCC1(c2ccccc2)NC(=O)N(Cc2cc(=O)n(C)c(=O)n2C)C1=O
InChIInChI=1S/C19H22N4O4/c1-4-10-19(13-8-6-5-7-9-13)16(25)23(17(26)20-19)12-14-11-15(24)22(3)18(27)21(14)2/h5-9,11H,4,10,12H2,1-3H3,(H,20,26)
InChIKeyDQGBWXCFOWMLAT-UHFFFAOYSA-N
MW370.41 g/mol
LogP0.83
Rot. Bonds5

About 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione

6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione (PubChem CID 17403045) has the molecular formula C19H22N4O4 and a molecular weight of 370.41 g/mol. Its IUPAC name is 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione
PubChem CID17403045
Molecular FormulaC19H22N4O4
Molecular Weight370.41 g/mol
Exact Mass370.16
IUPAC Name6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione
SMILESCCCC1(c2ccccc2)NC(=O)N(Cc2cc(=O)n(C)c(=O)n2C)C1=O
InChIInChI=1S/C19H22N4O4/c1-4-10-19(13-8-6-5-7-9-13)16(25)23(17(26)20-19)12-14-11-15(24)22(3)18(27)21(14)2/h5-9,11H,4,10,12H2,1-3H3,(H,20,26)
InChIKeyDQGBWXCFOWMLAT-UHFFFAOYSA-N
XLogP0.83
TPSA93.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione with MolForge

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Related Compounds

(5R)-3-[(4-chlorophenyl)methyl]-5-phenyl-5-propylimidazolidine-2,4-dione
CID 2585401
6-[[4-ethyl-4-(1-methylpyrazol-4-yl)-2,5-dioxoimidazolidin-1-yl]methyl]-1,3-dimethylpyrimidine-2,4-dione
CID 127661265
(5R)-3-[(2-fluorophenyl)methyl]-5-phenyl-5-propylimidazolidine-2,4-dione
CID 2585387
(5S)-3-[(3-fluorophenyl)methyl]-5-phenyl-5-propylimidazolidine-2,4-dione
CID 7986927
(5S)-3-[(4-tert-butylphenyl)methyl]-5-phenyl-5-propylimidazolidine-2,4-dione
CID 25465314
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]acetonitrile
CID 2585411
(5S)-5-phenyl-5-propyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazolidine-2,4-dione
CID 40882948
4-[[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]methyl]benzamide
CID 40820348
3-benzyl-5-nonyl-5-phenylimidazolidine-2,4-dione
CID 11417958
(5S)-3-(3-chloroprop-2-enyl)-5-phenyl-5-propylimidazolidine-2,4-dione
CID 7041273
(5R)-3-[(5-bromo-2-methoxyphenyl)methyl]-5-phenyl-5-propylimidazolidine-2,4-dione
CID 8572162
3-(2,3-dihydroxybutyl)-5-phenyl-5-propylimidazolidine-2,4-dione
CID 136574650

Frequently Asked Questions

What is the IUPAC name of 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
The IUPAC name of 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione (CID 17403045) is 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione is CCCC1(c2ccccc2)NC(=O)N(Cc2cc(=O)n(C)c(=O)n2C)C1=O.
What is the InChIKey of 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
The InChIKey is DQGBWXCFOWMLAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O4/c1-4-10-19(13-8-6-5-7-9-13)16(25)23(17(26)20-19)12-14-11-15(24)22(3)18(27)21(14)2/h5-9,11H,4,10,12H2,1-3H3,(H,20,26).
What are the key properties of 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione has a molecular weight of 370.41 g/mol, XLogP of 0.83, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 17403045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).